[Q-e-developers] Help with using QE

[Paolo Giannozzi]

This is not the appropriate place where to ask for general information
on QE. Anyway: in www.quantum-espresso.org, under "Resources",
"Tutorials", the fourth item is "IR and Raman spectra calculated with
Quantum ESPRESSO: mini-tutorial by Julen Larrucea"; in the sixth item,
"Hands-on Tutorial of Quantum ESPRESSO", there is also an oldish but
still valid tutorial on "IR and Raman cross sections, electron-phonon
coupling"

Paolo

On Wed, Jan 25, 2017 at 6:59 PM, Isaac Woods <isaac.woods.14 at cnu.edu> wrote:
> Hello.
>
> I'm an undergraduate student working with Quantum Espresso in a physical
> chemistry research group. My goal is to use the program to produce IR
> spectra. I have tried for months to look up tutorials on how to do this but
> I can't find any. Can someone help me with the steps to get IR spectra or
> point me to some useful resources? It would be preferable to get a
> step-by-step guide, but any amount of help will be great!
>
> Thanks
>
>
>
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-- 
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222